4-(furan-2-yl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)-6-(trifluoromethyl)pyrimidine
Chemical Structure Depiction of
4-(furan-2-yl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)-6-(trifluoromethyl)pyrimidine
4-(furan-2-yl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)-6-(trifluoromethyl)pyrimidine
Compound characteristics
| Compound ID: | C226-4711 |
| Compound Name: | 4-(furan-2-yl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)-6-(trifluoromethyl)pyrimidine |
| Molecular Weight: | 326.19 |
| Molecular Formula: | C11 H5 F3 N6 O3 |
| Smiles: | c1cc(c2cc(C(F)(F)F)nc(n2)n2cnc(n2)[N+]([O-])=O)oc1 |
| Stereo: | ACHIRAL |
| logP: | 2.4029 |
| logD: | 2.4029 |
| logSw: | -2.5584 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 82.291 |
| InChI Key: | MYRJIYXXMACKJG-UHFFFAOYSA-N |